1-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]-N-(4H-1,2,4-triazol-4-yl)methanimine
Chemical Structure Depiction of
1-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]-N-(4H-1,2,4-triazol-4-yl)methanimine
1-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]-N-(4H-1,2,4-triazol-4-yl)methanimine
Compound characteristics
| Compound ID: | 8005-1884 |
| Compound Name: | 1-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]-N-(4H-1,2,4-triazol-4-yl)methanimine |
| Molecular Weight: | 391.43 |
| Molecular Formula: | C20 H21 N7 O2 |
| Smiles: | C1CN(CCN1Cc1ccccc1)c1ccc(/C=N/n2cnnc2)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.8746 |
| logD: | 1.7977 |
| logSw: | -2.5478 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.979 |
| InChI Key: | PLZMUNGGLHLHHW-UHFFFAOYSA-N |